In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2008 | 28 | Yes |
Popular Name: 1-(1-benzyl-4-piperidyl)-4-[(2-methoxyphenyl)methyl]piperazine 1-(1-benzyl-4-piperidyl)-4-[(2-m…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 3.46 | 9.39 | -35.1 | 1 | 4 | 1 | 20 | 380.556 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.46 | 9.58 | -39.26 | 1 | 4 | 1 | 20 | 380.556 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.46 | 11.85 | -106.67 | 2 | 4 | 2 | 21 | 381.564 | 6 | ↓ |